Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:06:00 UTC
Update Date2025-03-24 21:55:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01933692
Frequency0.6
Structure
Chemical FormulaC5H9NO
Molecular Mass99.0684
SMILESC1NC2CC1CO2
InChI KeyJFLCTUFGJBISET-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxazinanes
Subclass 1,3-oxazinanes
Direct Parent 1,3-oxazinanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hemiaminals
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • pyrrolidines
  • tetrahydrofurans
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • tetrahydrofuran
  • 1,3-oxazinane
  • secondary amine
  • hemiaminal
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound
  • amine